SCHEMBL9355742

SCHEMBL9355742

CC(C)(C)c1cc(C(C)(C)C)c(OP(O)Oc2ccccc2O)c(C(C)(C)C)c1

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ HSD11B1 P28845 1/20 0.40
▸ HSD17B3 P37058 1/20 0.40
▸ ALDH1A1 P00352 4/20 0.40
▸ TSHR P16473 3/20 0.40
▸ TDP1 Q9NUW8 2/20 0.40
▸ CYP3A4 P08684 2/20 0.36
▸ CYP1A2 P05177 2/20 0.36
▸ CYP2C9 P11712 2/20 0.36
▸ CYP2C19 P33261 1/20 0.36
▸ TP53 P04637 2/20 0.36
▸ CA2 P00918 2/20 0.36
▸ CA1 P00915 1/20 0.36
▸ ALOX5 P09917 2/20 0.34
▸ PTGS2 P35354 2/20 0.34
▸ HDAC4 P56524 1/20 0.34
▸ HDAC2 Q92769 1/20 0.34
▸ HDAC8 Q9BY41 1/20 0.34
▸ ALOX15 P16050 4/20 0.32
▸ LMNA P02545 3/20 0.32
▸ HPGD P15428 2/20 0.32

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL2231433 0.89 ALDH1A1 (0.43) HSD11B1HSD17B3ALDH1A1TSHRTDP1
SCHEMBL11421838 0.83 GABRA1 (0.38) ALDH1A1TSHRTDP1CYP3A4CYP1A2
Catechol SCHEMBL9355747 0.82 ALDH1A1 (0.44) HSD11B1HSD17B3ALDH1A1TSHRTDP1
SCHEMBL11431393 0.81 GABRA1 (0.37) ALDH1A1TSHRTDP1CYP3A4CYP1A2
SCHEMBL8519938 0.75 POLB (0.36) ALDH1A1TSHRTDP1CYP3A4CYP1A2
SCHEMBL29413912 0.75 POLB (0.36) ALDH1A1TSHRTDP1CYP3A4CYP1A2
SCHEMBL27889522 0.75 APEX1 (0.41) HSD11B1HSD17B3ALDH1A1TSHRTDP1
SCHEMBL4154409 0.73 TSHR (0.39) ALDH1A1TSHRTDP1CYP3A4CYP1A2
SCHEMBL11254545 0.72 ALDH1A1 (0.45) ALDH1A1TSHRTDP1CYP1A2CYP2C19
SCHEMBL5865457 0.72 GABRA1 (0.38) ALDH1A1TSHRTDP1CYP3A4CYP1A2

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 9 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0254348-B1 PROCESS OF (CO)POLYMERIZATION OF ALPHA-OLEFINS IN THE PRESENCE OF ANTIOXIDANTS ENICHEM SYNTHESIS S.p.A. (IT) 1993-08-25 — — EP claimed
US-4824885-A PHOSPHITES OR PHOSPHONITES ENICHEM SINTESI S.P.A. (IT) 1989-04-25 — — US claimed
EP-0254348-A2 Process of (co)polymerization of alpha-olefins in the presence of antioxidants ENICHEM SYNTHESIS S.p.A. (IT) 1988-01-27 — — EP claimed
EP-0416321-B1 Crystalline polyolefin composition CHISSO CORP (JP) 1994-11-09 — — EP disclosed
EP-0254348-B1 PROCESS OF (CO)POLYMERIZATION OF ALPHA-OLEFINS IN THE PRESENCE OF ANTIOXIDANTS ENICHEM SYNTHESIS S.p.A. (IT) 1993-08-25 — — EP disclosed
US-5063264-A Molding materials CHISSO CORPORATION (JP) 1991-11-05 — — US disclosed
EP-0416321-A1 Crystalline polyolefin composition Chisso Corporation (JP) 1991-03-13 — — EP disclosed
US-4824885-A PHOSPHITES OR PHOSPHONITES ENICHEM SINTESI S.P.A. (IT) 1989-04-25 — — US disclosed
EP-0254348-A2 Process of (co)polymerization of alpha-olefins in the presence of antioxidants ENICHEM SYNTHESIS S.p.A. (IT) 1988-01-27 — — EP disclosed
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